ethyl 3-[2-[[(1R)-1-(furan-2-yl)ethyl]amino]ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-[[(1R)-1-(furan-2-yl)ethyl]amino]ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-[[(1R)-1-(2-furyl)ethyl]amino]acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[[(1R)-1-(2-furanyl)ethyl]amino]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[[(1R)-1-(furan-2-yl)ethyl]amino]acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-[[(1R)-1-(2-furyl)ethyl]amino]acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CNC(C)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)CN[C@H](C)C3=CC=CO3

InChI

InChI=1S/C21H22N2O4S/c1-3-26-21(25)20-16(12-18(28-20)15-8-5-4-6-9-15)23-19(24)13-22-14(2)17-10-7-11-27-17/h4-12,14,22H,3,13H2,1-2H3,(H,23,24)/t14-/m1/s1